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Lithium Ion Migration in Li-Si alloys: From First Principles Studies

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Figure

Table 1. Calculated lattice constants and corresponding experimental values for crystalline Li-Si alloys considered in this work
Figure 1. Migration pathways (inset) and energy profile of Li monovacancy migration in Li1Si1 bulk
Figure 2. Migration pathways (a) and energy profiles (b and c) of interstitial Li migration in Li1Si1bulk
Table 2. The surface energies of various low index Li1Si1 surfaces.
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